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2-(Hydroxymethyl)-2-[[(1-oxoallyl)oxy]methyl]-1,3-propandiyldiacrylat

Pentaerythritol triacrylate

HCID 19042
NotizenReaktionen
GrundinformationenÜberblickNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
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Grundinformationen

CAS
3524-68-3
Standard-SMILES
C=CC(=O)OCC(CO)(COC(=O)C=C)COC(=O)C=C
InChIKey
HVVWZTWDBSEWIH-UHFFFAOYSA-N
Summenformel
C14H18O7
Durchschnittliche Molmasse
298,29 g/mol
Monoisotopische Masse
298,10525291

Überblick

Thick clear yellow liquid. (NTP, 1992)

Namen und Bezeichner

Bevorzugter Name
Pentaerythritol triacrylate
IUPAC
[2-(hydroxymethyl)-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate
Lokaler Name
2-(Hydroxymethyl)-2-[[(1-oxoallyl)oxy]methyl]-1,3-propandiyldiacrylat
Englischer Name
Pentaerythritol triacrylate
Summenformel
C14H18O7
Molmasse
298.29

Namen und Synonyme

Pentaerythritol triacrylate3524-68-3PETAPentaerythrityl triacrylateGafgard 233Kayarad PET 30Sartomer SR 444Setalux UV 2242Aronix M 305Light Acrylate PE 3AP 300 (acrylate)NK Ester TMM 50T
Weitere Namen anzeigen
PET3A2-((Acryloyloxy)Methyl)-2-(hydroxyMethyl)propane-1,3-diyl diacrylatePETIAsr444sartomersr444acrylic acid [2,2-bis(acryloyloxymethyl)-3-hydroxy-propyl] estersr444ctriacryLaronixm305
Tetramethylolmethane triacrylateNK Ester A-TMM 3NK Ester A-TMM 3LDTXSID2025842SR 444CAcrylic acid, triester with pentaerythritolSR 444PJJ1161ULF

Datenbank-Bezeichner

CAS
3524-68-3
PubChem CID
19042
DTXSID

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,1
Polarare Oberfläche (TPSA)
99,1 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
7
Frei drehbare Bindungen
13
Schwere Atome
21
Formalladung
0
Komplexität
365

Experimentelle und physikochemische Eigenschaften

PolymersPlastics & Rubber -> (Meth)acrylates
SpringerMaterials PropertiesBoiling point
SolubilityInsoluble (<1 mg/ml at 64 °F) (NTP, 1992)
Boiling Point401 to 419 °F at 760 mmHg (Detonates) (NTP, 1992)
Physical Description · 3 Einträge

Thick clear yellow liquid. (NTP, 1992)

Liquid

Thick yellow liquid; [CAMEO] Clear liquid; [Alfa Aesar MSDS]

Collision Cross Section165.1 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID2025842]

Physikochemische Eigenschaften

Schmelzpunkt
15 ℃ · 15℃
Siedepunkt
359.71 °C · 359.71°C (rough estimate)
Dichte
1.18 g/mL · 1.18 g/mL at 25 °C (lit.)

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 6 Einträge

Warning

H315: Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P332+P317, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Warning

H302 (26.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: 2-Propenoic acid, 2-(hydroxymethyl)-2-[[(1-oxo-2-propenyl)oxy]methyl]-1,3-propanediyl ester

2-Propenoic acid, 1,1'-[2-(hydroxymethyl)-2-[[(1-oxo-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propenoic acid, 1,1'-[2-(hydroxymethyl)-2-[[(1-oxo-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

2-Propenoic acid, 2-(hydroxymethyl)-2-[[(1-oxo-2-propenyl)oxy]methyl]-1,3-propanediyl ester: HSNO Approval: HSR002735 Approved with controls

DOT LabelCorrosive
Fire HazardsThe flash point of this compound has not been determined, but it is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms involved in exposure to this compound may include irritation to the skin and eyes.
Hazards Summary · 1 Eintrag

Chemie und Industrie

Verwendung und Herstellung

Uses · 2 Einträge

Used in UV-cured inks or varnishes and dental polymers; [Kanerva, p. 1744] Used to make various inks and coatings, in photoresists, printing inks and plates, acrylic glues, adhesives, alkyds, binders, paper and wood impregnates, wire and cable extrusion, polymer impregnated concrete and as a modifier for polyester and fiberglass; [NTP]

Semiconductor Manufacturing [Category: Industry]

U.S. Production2023: 700,000 - <850,000 lb
Consumer UsesMonomers
Industry UsesPhotosensitive chemicals
General Manufacturing Information · 2 Einträge

Miscellaneous Manufacturing

2-Propenoic acid, 1,1'-[2-(hydroxymethyl)-2-[[(1-oxo-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] ester: ACTIVE

Anwendungen

VerwendenPentaerythritol triacrylate is used in adhesives, coatings, inks, photoresists, castings, etc. cured by UV radiation; in organic synthesis.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

2-PropensäurePentaerythritol

Anbieter100 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
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Zugehörige Reaktionen

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Notizen zur Verbindung

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Auf dieser SeiteGrundinformationenÜberblickNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
DTXSID2025842
ChEMBL
CHEMBL1602699
UNII
PJJ1161ULF
EC Number
222-540-8
Nikkaji
J13.724C
Brechungsindex
20 · n20/D 1.483(lit.)
Flammpunkt
230 °F · >230 °F
storage temp.
Inert atmosphere,Room Temperature
Löslichkeit
Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand
Liquid
pka
13.63 · 13.63±0.10(Predicted)
Farbe
Colorless
Wichte
1.16 · 1.16-1.19
Wasserlöslichkeit
Immiscible with water.
BRN
6598752 · 6598752
Stabilität
Stable at room temperature, but potentially explosive at elevated temperatures. Combustible, but may explode if involved in a fire.
InChIKey
HVVWZTWDBSEWIH-UHFFFAOYSA-N
CAS Datenbank
3524 · 3524-68-3(CAS DataBase Reference)
NIST chemische Informationen
2 · 2-Propenoic acid, 2-(hydroxymethyl)-2-[[(1-oxo-2-propenyl)oxy]methyl]-1,3-propanediyl ester(3524-68-3)
EPA chemische Informationen
Pentaerythritol triacrylate (3524-68-3)

Allergic contact dermatitis reported in dental technicians and fabric printers; [Kanerva, p. 1744] Occupational asthma confirmed in a worker exposed to triacrylate (unspecified) from a thermal printer; [Malo] May cause skin and eye irritation; [CAMEO] May polymerize; A skin and strong eye irritant; May cause skin sensitization; [Alfa Aesar MSDS]

Reactive GroupAlcohols and Polyols
Reactivity AlertsPolymerizable
Reactivity ProfilePENTAERYTHRITOL TRIACRYLATE is explosively unstable at temperatures near its boiling point (NTP, 1992).
Air and Water ReactionsInsoluble in water.
Hazard Classes and Categories · 5 Einträge

Acute Tox. 4 (26.4%)

Eye irritation - category 2

Acute toxicity (Oral) - Category 4

Acute toxicity (Oral) - Category 4

Skin Irrit. 2

Sicherheit und Schutzausrüstung

Fire FightingFires involving this material can be controlled using a dry chemical, carbon dioxide or Halon extinguisher. Because this material is potentially explosive, fire should be fought from a safe distance. (NTP, 1992)
First Aid · 1 Eintrag

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 Eintrag

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, you should dampen the solid spill material with alcohol, then transfer the dampened material to a suitable container. Use absorbent paper dampened with alcohol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with alcohol followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Personal Protective Equipment (PPE) · 1 Eintrag

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Toxikologische Informationen

Adverse EffectsSkin Sensitizer - An agent that can induce an allergic reaction in the skin.

Sicherheitsdaten

F
3-8-10
wgk
1
tsca
TSCA listed
ridadr
UN3265
hs_code
29161900
RTECS-Nr.
UD3370000
risk_code
36/38-43
Toxizität
LD50 orl-rat: 2460 mg/kg TXAPA9 28,313,74
hazard_code
Xi
safety_code
39
hazard_class
8
packing_group
III
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